2WQ5
Non-antibiotic properties of tetracyclines: structural basis for inhibition of secretory phospholipase A2.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 |
| Temperature [K] | 110 |
| Detector technology | CCD |
| Collection date | 2008-01-10 |
| Detector | RIGAKU CCD |
| Spacegroup name | P 21 3 |
| Unit cell lengths | 68.712, 68.712, 68.712 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 34.360 - 1.650 |
| R-factor | 0.191 |
| Rwork | 0.189 |
| R-free | 0.23000 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1a3d |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.459 |
| Data reduction software | CrystalClear |
| Data scaling software | CrystalClear |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 34.400 | 1.710 |
| High resolution limit [Å] | 1.650 | 1.650 |
| Rmerge | 0.090 | 0.530 |
| Number of reflections | 13314 | |
| <I/σ(I)> | 10.6 | 2.1 |
| Completeness [%] | 100.0 | 99.9 |
| Redundancy | 10.8 | 6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 26% PEG 4000, 0.24M (NH4)2SO4 |
